2-[1-iodanyl-2,3-bis(oxidanyl)propyl]-2-sulfo-butanedioic acid

Systemtic Name: 2-[1-iodanyl-2,3-bis(oxidanyl)propyl]-2-sulfo-butanedioic acid Openeye Name: 2-(2,3-dihydroxy-1-iodo-propyl)-2-sulfo-butanedioic acid CAS Name: 2-(2,3-dihydroxy-1-iodopropyl)-2-sulfobutanedioic acid IUPAC Name: 2-(2,3-dihydroxy-1-iodopropyl)-2-sulfobutanedioic acid Traditional Name: 2-(2,3-dihydroxy-1-iodo-propyl)-2-sulfo-succinic acid Formula: C7H11IO9S MolecularWeight: 398.12631

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C(C(C(C(CC(=O)O)(C(=O)O)S(=O)(=O)O)I)O)O

Isomeric SMILES

C(C(C(C(CC(=O)O)(C(=O)O)S(=O)(=O)O)I)O)O

InChI

InChI=1S/C7H11IO9S/c8-5(3(10)2-9)7(6(13)14,1-4(11)12)18(15,16)17/h3,5,9-10H,1-2H2,(H,11,12)(H,13,14)(H,15,16,17)